((3S,4R,5R)-3,4-DIHYDROXY-5-(((2R,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(3,4,5-TRIMETHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-YL)METHOXY)TETRAHYDROFURAN-3-YL)METHYL 4-HYDROXY-3,5-DIMETHOXYBENZOATE

CAS号
1014974-98-1
CCD编号
CCD07144365
分子式
C29 H38 O17
分子量
658.602

基本信息

产品名称: ((3S,4R,5R)-3,4-DIHYDROXY-5-(((2R,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(3,4,5-TRIMETHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-YL)METHOXY)TETRAHYDROFURAN-3-YL)METHYL 4-HYDROXY-3,5-DIMETHOXYBENZOATE
CAS: 1014974-98-1
英文同义词: ((3S,4R,5R)-3,4-DIHYDROXY-5-(((2R,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(3,4,5-TRIMETHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-YL)METHOXY)TETRAHYDROFURAN-3-YL)METHYL 4-HYDROXY-3,5-DIMETHOXYBENZOATE
MDL号: MFCD22124429
氢键受体数量: 17
氢键供体数量: 6
Smile: COc1cc(cc(c1O)OC)C(=O)OC[C@]2(CO[C@H]([C@@H]2O)OC[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)Oc4cc(c(c(c4)OC)OC)OC)O)O)O)O
InChi: InChI=1S/C29H38O17/c1-37-15-6-13(7-16(38-2)20(15)30)26(35)43-11-29(36)12-44-28(25(29)34)42-10-19-21(31)22(32)23(33)27(46-19)45-14-8-17(39-3)24(41-5)18(9-14)40-4/h6-9,19,21-23,25,27-28,30-34,36H,10-12H2,1-5H3/t19-,21-,22+,23-,25+,27-,28-,29-/m1/s1
InChiKey: InChIKey=JXFLXUHEPVEMKK-UTDQSPDHSA-N

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